Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | DHFR | P00374 | 1/20 | 0.42 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.42 |
| ▸ | TUBB | P07437 | 1/20 | 0.42 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.42 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.42 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.42 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.42 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.42 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.42 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.42 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL28640288 | 0.82 | CA1 (0.55) | KMT2AHTR1AHTR3AHAO1HTT | |
| SCHEMBL31345525 | 0.82 | CA1 (0.60) | KMT2AHTR1AHTR3AHAO1HTT | |
| SCHEMBL4442278 | 0.82 | APOBEC3G (0.73) | APOBEC3GSLC6A4SLC6A2 | |
| SCHEMBL4644640 | 0.82 | CA1 (0.60) | KMT2AHTR1AHTR3AHAO1HTT | |
| SCHEMBL27632178 | 0.82 | KMT2A (0.59) | KMT2AHTR1AHTR3AHAO1HTT | |
| Lithium SCHEMBL9505754 | 0.80 | CA1 (0.57) | KMT2AHTR1AHTR3AHAO1HTT | |
| SCHEMBL9505741 | 0.80 | CA1 (0.57) | KMT2AHTR1AHTR3AHAO1HTT | |
| SCHEMBL6792300 | 0.80 | MMP2 (0.60) | KMT2AHTTMTNR1AMTNR1BCA12 | |
| SCHEMBL27617014 | 0.79 | KMT2A (0.56) | KMT2AHTR1AHTR3AHAO1HTT | |
| SCHEMBL27635780 | 0.79 | KMT2A (0.61) | KMT2ASLC6A4HTR1AHTR3ASLC6A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100371319-C | Prepn and application of N-[2-(aryloxy)ethyl]-2-(arylthio) benzyl amine derivative | UNIV TIANJIN (CN) | 2008-02-27 | — | — | CN | disclosed |
| CN-1706820-A | Prepn and application of N-[2-(aryloxy)ethyl]-2-(arylthio) benzyl amine derivative | UNIV TIANJIN (CN) | 2005-12-14 | — | — | CN | disclosed |
| CN-1696121-A | 4-[2-(artyl sulfo) benzyl]-1-derivative of aryl-piperazine, preparation method and application | UNIV TIANJIN (CN) | 2005-11-16 | — | — | CN | disclosed |